494275
Chloroform-d
"100%", 99.96 atom % D, contains 0.03 % (v/v) TMS
Synonym(s):
Deuterochloroform
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About This Item
Linear Formula:
CDCl3
CAS Number:
Molecular Weight:
120.38
UNSPSC Code:
12142201
NACRES:
NA.21
PubChem Substance ID:
EC Number:
212-742-4
Beilstein/REAXYS Number:
1697633
MDL number:
Isotopic purity:
99.96 atom % D
Assay:
≥99.00%
Mass shift:
M+1
Quality Level
isotopic purity
99.96 atom % D
assay
≥99.00%
contains
0.03 % (v/v) TMS
technique(s)
NMR: suitable
impurities
≤0.0100% water
water
refractive index
n20/D 1.444 (lit.)
bp
60.9 °C (lit.)
mp
−64 °C (lit.)
density
1.500 g/mL at 25 °C (lit.)
mass shift
M+1
SMILES string
[2H]C(Cl)(Cl)Cl
InChI
1S/CHCl3/c2-1(3)4/h1H/i1D
InChI key
HEDRZPFGACZZDS-MICDWDOJSA-N
General description
Chloroform-d (deuterochloroform, CDCl3) is a deuterated NMR solvent containing 0.03% (v/v) TMS (tetramethylsilane). It is useful in NMR-based research and analyses. It may be synthesized by reacting trichloroacetophenone and sodium deuteroxide. The influence of the number of pulses on its multiphoton decomposition (MPD) has been studied. Infrared spectral studies of C-D stretching and bending motions of CDCl3 in different solvents have been investigated. The effect of chloroform-d on the interaction of water with activated carbons has been analyzed. The dependence of molecular reorientation of deuterated chloroform on pressure and temperature has been studied by Raman spectroscopy.
Application
Chloroform-d may be used in the synthesis of dichlorofluoromethane-d.
Other Notes
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signalword
Danger
Hazard Classifications
Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Carc. 2 - Eye Irrit. 2 - Repr. 2 - Skin Irrit. 2 - STOT RE 1 Oral - STOT SE 3
target_organs
Central nervous system, Liver,Kidney
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
ppe
Eyeshields, Faceshields, Gloves
Regulatory Information
危险化学品
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Related Content
Isotope Effect on Dissociation Probabilities in the Mass Spectra of Chloroform and Chloroform-d.
Dibeler VH and Bernstein RB.
J. Chem. Phys., 19(4), 404-406 (1951)
Influence of organics on the structure of water adsorbed on activated carbons.
Turov VV, et al.
Journal of Colloid and Interface Science, 253(1), 23-34 (2002)
Raman study of molecular reorientation in liquid chloroform and chloroform-d under high pressure.
Schroeder J, et al.
J. Chem. Phys. , 69(12), 5479-5488 (1978)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 494275-10X0.75ML | 04061832407838 |
| 494275-10G | 04061832407821 |
| 494275-50G | 04061837659003 |